methyl 4-oxo-3-[(thiophen-2-yl)methyl]-2-{[3-(trifluoromethyl)phenyl]imino}-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
Chemical Structure Depiction of
methyl 4-oxo-3-[(thiophen-2-yl)methyl]-2-{[3-(trifluoromethyl)phenyl]imino}-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
methyl 4-oxo-3-[(thiophen-2-yl)methyl]-2-{[3-(trifluoromethyl)phenyl]imino}-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
Compound characteristics
| Compound ID: | 8016-2097 |
| Compound Name: | methyl 4-oxo-3-[(thiophen-2-yl)methyl]-2-{[3-(trifluoromethyl)phenyl]imino}-3,4-dihydro-2H-1,3-thiazine-6-carboxylate |
| Molecular Weight: | 426.43 |
| Molecular Formula: | C18 H13 F3 N2 O3 S2 |
| Smiles: | COC(C1=CC(N(Cc2cccs2)/C(=N/c2cccc(c2)C(F)(F)F)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4565 |
| logD: | 4.4546 |
| logSw: | -4.4733 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.24 |
| InChI Key: | YRHMTADLDWWJRL-UHFFFAOYSA-N |